2-Isopropyl-5-methyl-2-hexenal
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2-Isopropyl-5-methyl-2-hexenal
structure -
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CAS No:
35158-25-9
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Formula:
C10H18O
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Chemical Name:
2-Isopropyl-5-methyl-2-hexenal
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Synonyms:
2-Hexenal,5-methyl-2-(1-methylethyl)-;2-Hexenal,2-isopropyl-5-methyl-;5-Methyl-2-(1-methylethyl)-2-hexenal;2-Isopropyl-5-methyl-2-hexenal;2-Isopropyl-5-methyl-2-hexen-1-al;α-Isopropyl-β-isobutylacrolein;2-(1-Methylethyl)-5-methylhex-2-enal
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CAS No:
Characteristics
17.07000
2.81380
0.8454 g/cm3 @ Temp: 20 °C
49.5-50 °C @ Press: 3.5 Torr
145 °F
n20/D 1.452(lit.)
Insoluble in water|soluble (in ethanol)
Safety Information
III
3
1989
2
10-36/37/38
16-26-36
MP6450000
Xi
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P321, P332+P313, and P362|Aggregated GHS information provided by 1448 companies from 9 notifications to the ECHA C&L Inventory.
2-Isopropyl-5-methyl-2-hexenal Use and Manufacturing
2-Hexenal, 5-methyl-2-(1-methylethyl)-: ACTIVE
Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index
Flavoring Agents
Computed Properties
Molecular Weight:154.25
XLogP3:2.9
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:154.135765193
Monoisotopic Mass:154.135765193
Topological Polar Surface Area:17.1
Heavy Atom Count:11
Complexity:143
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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